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Hydratropyl alcohol (β-Methylphenethyl alcohol)

CAS 1123-85-9C9H12OMW 136.09 g/mol

Hydratropyl alcohol (β-Methylphenethyl alcohol) (CAS 1123-85-9) — formula C9H12O, molecular weight 136.09 g/mol.

Product Overview

CAS Number1123-85-9
Molecular FormulaC9H12O
Molecular Weight136.09 g/mol
Boiling Point113.00 to 114.00 °C. @ 14.00 mm Hg
LogP2.4

Technical Profile

What this product is

Hydratropyl alcohol (β-Methylphenethyl alcohol) is a chemical compound with CAS registry number 1123-85-9 and molecular formula C9H12O (molecular weight 136.09 g/mol).

Identification

CAS number: 1123-85-9

Its molecular formula C9H12O comprises 9 C, 12 H, 1 O atoms.

Also known as: Hydratropyl alcohol (β-Methylphenethyl alcohol) · 2-Phenyl-1-propanol

Frequently Asked Questions

What is the CAS number of Hydratropyl alcohol (β-Methylphenethyl alcohol)?

The CAS registry number of Hydratropyl alcohol (β-Methylphenethyl alcohol) is 1123-85-9.

What is the molecular formula and molecular weight of Hydratropyl alcohol (β-Methylphenethyl alcohol)?

Molecular formula C9H12O, molecular weight 136.09 g/mol.

What other names is Hydratropyl alcohol (β-Methylphenethyl alcohol) known by?

It is also registered under: Hydratropyl alcohol (β-Methylphenethyl alcohol), 2-Phenyl-1-propanol.

PubChem Public Data

Independent reference data for Hydratropyl alcohol (β-Methylphenethyl alcohol) (CAS 1123-85-9), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number1123-85-9
PubChem CID14295
Molecular formulaC9H12O
Molecular weight136.09 g/mol
IUPAC name2-phenylpropan-1-ol
InChIKeyRNDNSYIPLPAXAZ-UHFFFAOYSA-N
UNII (FDA)27ZYZ88DWU
ChEBI IDCHEBI:193640
FEMA number2732
JECFA number1459

Computed descriptors

Molecular Weight136.19
XLogP32.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass136.088815002
Monoisotopic Mass136.088815002
Topological Polar Surface Area20.2
Heavy Atom Count10

Physicochemical values on record

Boiling Point113.00 to 114.00 °C. @ 14.00 mm Hg
Boiling Point219 °C
Density0.971-0.978
Refractive Index1.523-1.530

Documented uses on record

    Used as a flavoring agent; [FDA]Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

    Synonyms and trade names

    2-Phenylpropan-1-ol; 2-Phenyl-1-propanol; 1123-85-9; Hydratropic alcohol; beta-Methylphenethyl alcohol; 2-Phenylpropyl alcohol; Hydratropyl alcohol; 1-Hydroxy-2-phenylpropane; 2-Phenylpropanol-1; 1-Propanol, 2-phenyl-; Benzeneethanol, beta-methyl-; FEMA No. 2732; DTXSID8037756; NSC-5232; 27ZYZ88DWU; PHENETHYL ALCOHOL, beta-METHYL-

    Regulatory listings held on file

    Regulatory & Food ContactEU Flavoring substances
    FDA Substance added to food: FLAVORING AGENT OR ADJUVANT
    Flavoring Agents
    FLAVOURING_AGENT: Flavouring Agent
    Floral
    No safety concern at current levels of intake when used as a flavouring agent
    GHS notification summary93.1% (268 / 288)

    GHS hazard classification

    GHS notification summary93.1% (268 / 288)

    This chemical does not meet GHS hazard criteria for 93.1% (268 of 288) of all reports.

    Reported as not meeting GHS hazard criteria by 268 of 288 companies (only 6.9% companies provided GHS information). For more detailed information, please visit ECHA C&L website.

    What the public record says

    Hydratropyl alcohol (β-Methylphenethyl alcohol) is identified by CAS 1123-85-9, molecular formula C9H12O and molecular weight 136.09 g/mol. UNII 27ZYZ88DWU; ChEBI 193640; InChIKey RNDNSYIPLPAXAZ-UHFFFAOYSA-N. Boiling Point: 113.00 to 114.00 °C. @ 14.00 mm Hg; Boiling Point: 219 °C; Density: 0.971-0.978.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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